CID 34660

N,n-dimethyl-n',n'-diphenyl-ethylenediamine hydrochloride

Structural Information

Molecular Formula
C16H20N2
SMILES
CN(C)CCN(C1=CC=CC=C1)C2=CC=CC=C2
InChI
InChI=1S/C16H20N2/c1-17(2)13-14-18(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12H,13-14H2,1-2H3
InChIKey
BVSCXLNOACOCHU-UHFFFAOYSA-N
Compound name
N,N-dimethyl-N',N'-diphenylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

240.16264 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.16992 157.2
[M+Na]+ 263.15186 161.5
[M-H]- 239.15536 165.9
[M+NH4]+ 258.19646 174.9
[M+K]+ 279.12580 159.7
[M+H-H2O]+ 223.15990 148.4
[M+HCOO]- 285.16084 183.9
[M+CH3COO]- 299.17649 204.7
[M+Na-2H]- 261.13731 163.4
[M]+ 240.16209 158.0
[M]- 240.16319 158.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe